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Home Fluorides 261951-91-1
261951-91-1,MFCD01631542
Catalog No.:AA002S3I

261951-91-1 | 2-Methyl-4-(trifluoromethoxy)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$103.00   $73.00
- +
250mg
95%
in stock  
$142.00   $99.00
- +
1g
95%
in stock  
$215.00   $150.00
- +
5g
95%
in stock  
$570.00   $399.00
- +
10g
95%
in stock  
$946.00   $662.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002S3I
Chemical Name:
2-Methyl-4-(trifluoromethoxy)benzoic acid
CAS Number:
261951-91-1
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
MDL Number:
MFCD01631542
SMILES:
OC(=O)c1ccc(cc1C)OC(F)(F)F
Properties
Computed Properties
 
Complexity:
239  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3  

Downstream Synthesis Route
261951-91-1   
2-methyl-2-(2-methyl-4-{3-(2-methyl-4-trifluoromethoxy-benzoylamino)-rnethyl-phenoxy}-phenoxy)-propionicacid 

[1]Shi,Qing;Canada,EmilyJ.;Xu,Yanping;Warshawsky,AlanM.;Etgen,GarretJ.;Broderick,CarolL.;Clutinger,CathleenK.;Irwin,LynnieA.;Laurila,MichaelE.;Montrose-Rafizadeh,Chahrzad;Oldham,BrianA.;Wang,Minmin;Winneroski,LeonardL.;Xie,Chaoyu;York,JeremyS.;Yumibe,NathanP.;Zink,RichardW.;Mantlo,Nathan[BioorganicandMedicinalChemistryLetters,2007,vol.17,#24,p.6744-6749]

[1]CurrentPatentAssignee:AICURISGMBH&CO.KG-US2009/181996,2009,A1Locationinpatent:Page/Pagecolumn10

[2]CurrentPatentAssignee:AICURISGMBH&CO.KG-WO2006/8046,2006,A1Locationinpatent:Page/Pagecolumn48-49

[3]CurrentPatentAssignee:AICURISGMBH&CO.KG-US2008/261964,2008,A1Locationinpatent:Page/Pagecolumn10

261951-91-1    75-05-8   
2-acetyl-5-(trifluoromethoxy)isoindolin-1-one 

[1]Liu,Cong;Zhang,Qi;Li,Hongbo;Guo,Shuangxi;Xiao,Bin;Deng,Wei;Liu,Lei;He,Wei[Chemistry-AEuropeanJournal,2016,vol.22,#18,p.6208-6212]

2-methyl-4-trifluoromethoxy-phenylamine 
  261951-91-1 

[1]CurrentPatentAssignee:PRAXISPRECISIONMEDICINESINC-WO2018/98500,2018,A1

Literature
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SDS
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Tags:261951-91-1 Molecular Formula|261951-91-1 MDL|261951-91-1 SMILES|261951-91-1 2-Methyl-4-(trifluoromethoxy)benzoic acid